![4-butoxy-N-[(3-chloro-2-methylphenyl)carbamothioyl]benzamide structure](/static/products/4284/428485-66-9.webp)
4-butoxy-N-[(3-chloro-2-methylphenyl)carbamothioyl]benzamide
TL;DR: 4-butoxy-N-[(3-chloro-2-methylphenyl)carbamothioyl]benzamide (CAS 428485-66-9) is a chemical compound with molecular formula C19H21ClN2O2S and molecular weight 376.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-butoxy-N-[(3-chloro-2-methylphenyl)carbamothioyl]benzamide
Also Known As: 4-butoxy-N-[(3-chloro-2-methylphenyl)carbamothioyl]benzamide, N-(4-butoxybenzoyl)-N'-(3-chloro-2-methylphenyl)thiourea
| Molecular Formula | C19H21ClN2O2S |
|---|---|
| Molecular Weight | 376.10 g/mol |
| LogP | 4.95412 |
| Topological Polar Surface Area | 50.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 376.10123 |
| Heavy Atoms | 25 |
| Complexity | 747.58936 |
Chemical Identifiers
| CAS Number | 428485-66-9 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C(=CC=C2)Cl)C |
Product Overview
4-butoxy-N-[(3-chloro-2-methylphenyl)carbamothioyl]benzamide (CAS 428485-66-9), with molecular formula C19H21ClN2O2S and molecular weight 376.10 g/mol. IUPAC: 4-butoxy-N-[(3-chloro-2-methylphenyl)carbamothioyl]benzamide.
Chemical Property Profile of 4-butoxy-N-[(3-chloro-2-methylphenyl)carbamothioyl]benzamide
Property Insights of 4-butoxy-N-[(3-chloro-2-methylphenyl)carbamothioyl]benzamide
The XLogP value of 4.95412 indicates that 4-butoxy-N-[(3-chloro-2-methylphenyl)carbamothioyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.36 Ų, 4-butoxy-N-[(3-chloro-2-methylphenyl)carbamothioyl]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-butoxy-N-[(3-chloro-2-methylphenyl)carbamothioyl]benzamide has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-butoxy-N-[(3-chloro-2-methylphenyl)carbamothioyl]benzamide?
The CAS number of 4-butoxy-N-[(3-chloro-2-methylphenyl)carbamothioyl]benzamide is 428485-66-9.
What is the molecular formula of 4-butoxy-N-[(3-chloro-2-methylphenyl)carbamothioyl]benzamide?
The molecular formula of 4-butoxy-N-[(3-chloro-2-methylphenyl)carbamothioyl]benzamide is C19H21ClN2O2S.
What is the molecular weight of 4-butoxy-N-[(3-chloro-2-methylphenyl)carbamothioyl]benzamide?
The molecular weight of 4-butoxy-N-[(3-chloro-2-methylphenyl)carbamothioyl]benzamide is 376.10 g/mol.
Where can I buy 4-butoxy-N-[(3-chloro-2-methylphenyl)carbamothioyl]benzamide?
You can request a quote for 4-butoxy-N-[(3-chloro-2-methylphenyl)carbamothioyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-butoxy-N-[(3-chloro-2-methylphenyl)carbamothioyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-butoxy-N-[(3-chloro-2-methylphenyl)carbamothioyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.